⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL20759402 | 0.75 | CTH (0.41) | — | |
| SCHEMBL18782544 | 0.75 | NOS3 (0.39) | — | |
| SCHEMBL7702027 | 0.73 | APLNR (0.32) | — | |
| SCHEMBL20748844 | 0.72 | — | — | |
| SCHEMBL20312826 | 0.72 | FGF23 (0.36) | — | |
| SCHEMBL32671450 | 0.70 | — | — | |
| SCHEMBL8089195 | 0.70 | — | — | |
| SCHEMBL19365338 | 0.70 | — | — | |
| SCHEMBL3915965 | 0.70 | FGF23 (0.40) | — | |
| SCHEMBL3915967 | 0.70 | FGF23 (0.40) | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11566003-B2 | Isoquinolines as inhibitors of HPK1 | GENENTECH, INC. (US) | 2023-01-31 | — | — | US | disclosed |
| US-20210163417-A1 | ISOQUINOLINES AS INHIBITORS OF HPK1 | GENENTECH, INC. (US) | 2021-06-03 | — | — | US | disclosed |
| EP-2270064-B1 | Organic semiconductor polymer, transistor including an organic semiconductor polymer and methods of fabricating the same | SAMSUNG ELECTRONICS CO LTD (KR) | 2020-02-19 | — | — | EP | disclosed |